7-chloranyl-2-[(4-pentan-3-ylpyridin-1-ium-1-yl)methyl]-1H-quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[(4-pentan-3-ylpyridin-1-ium-1-yl)methyl]-1H-quinazolin-4-one Openeye Name: 7-chloro-2-[[4-(1-ethylpropyl)pyridin-1-ium-1-yl]methyl]-1H-quinazolin-4-one CAS Name: 7-chloro-2-[(4-pentan-3-yl-1-pyridin-1-iumyl)methyl]-1H-quinazolin-4-one IUPAC Name: 7-chloro-2-[(4-pentan-3-ylpyridin-1-ium-1-yl)methyl]-1H-quinazolin-4-one Traditional Name: 7-chloro-2-[[4-(1-ethylpropyl)pyridin-1-ium-1-yl]methyl]-1H-quinazolin-4-one Formula: C19H21ClN3O+ MolecularWeight: 342.84254

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=CC=[N+](C=C1)CC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

Isomeric SMILES

CCC(CC)C1=CC=[N+](C=C1)CC2=NC(=O)C3=C(N2)C=C(C=C3)Cl

InChI

InChI=1S/C19H20ClN3O/c1-3-13(4-2)14-7-9-23(10-8-14)12-18-21-17-11-15(20)5-6-16(17)19(24)22-18/h5-11,13H,3-4,12H2,1-2H3/p+1